3-Phenylisobenzofuran-1(3H)-One 3-苯基苯酞

CAS 5398-11-8 MFCD00023099

化学结构图

5398-11-8
SMILES: O=C1O[C@@H](c2ccccc2)c2ccccc21

化学属性

Mol. FormulaC14H10O2
Mol. Weight210.23
Melting Point115.0 to 119.0 deg-C
TSCANo

别名和识别编码

Chemical Name3-Phenylisobenzofuran-1(3H)-One
Synonym 3-Phenyl-1(3H)-isobenzofuranone 3-苯基苯酞 3-phenylphthalide TIMTEC-BB SBB008407 Phthalide, 3-phenyl- 3-PHENYL-1(3H)-ISOBENZOFURANONE 3 - Phenylphthalide 3-Phenylphthalide 1(3H)-Isobenzofuranone, 3-phenyl- 3-phenyl-phthalid AURORA KA-7267 3-phenyl-1(3h)-isobenzofuranon 3-PHENYLPHTHALIDE
CAS Number5398-11-8
MDL NumberMFCD00023099
EC Number226-426-9
Beilstein Registry Number17(5)10,452
Reaxys-RN159678
PubChem Substance ID87560754
Chemical Name Translation3-苯基苯酞
InChIKeySQFMIHCARVMICF-UHFFFAOYSA-N
Wiswesser Line NotationT56 BVO DHJ DR
LabNetwork Molecule IDLN00242704
InChIInChI=1S/C14H10O2/c15-14-12-9-5-4-8-11(12)13(16-14)10-6-2-1-3-7-10/h1-9,13H
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分类

  • {uni_hamburg} no charge; oxygen heterocycle; carbocycle; aromatic; alicycle; large ring; fused rings; 5ring; 6ring; 9ring; ester; lactone; racemate; 1fragment

相关文献及参考

  • Short: III/10a Title: Structure Data of Organic Crystals: C ... C 15 Author: Schudt-Weitz, G.; Strell, I. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/10a Year: 1985 ISBN: 3-540-07834-7 ISBN: 978-3-540-07834-0 Internet Resource: DOI:10.1007/b19984 RefComment: XXII, 634 pages. Hardcover Abstract: The volume includes an alphabetical index of all substances and a separate "ring index" with all cyclic compounds.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

RTECSTI3800000
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#05535

其他信息

  • 3-苯基苯酞价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P1806 3-苯基苯酞 3-Phenylphthalide 5G 571元 2014/06/02 P1806 3-苯基苯酞 3-Phenylphthalide 25G 2070元 2010/05/25 L16181 3-苯基苯酞, 99% 3-Phenylphthalide, 99% 5g 437元
  • Alfa Aesar:3-苯基苯酞,99% 3-Phenylphthalide, 99%(5398-11-8)
  • Sigma Aldrich:5398-11-8(sigmaaldrich)
  • MOL 文件:5398-11-8.mol
  • TCI Shanghai:3-苯基苯酞 3-Phenylphthalide,>;98.0%(GC)(5398-11-8)

系列性分类

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